methyl 3-[2-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-[(9,10-dioxo-1-anthryl)amino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[(9,10-dioxo-1-anthracenyl)amino]-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[(9,10-dioxoanthracen-1-yl)amino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[(9,10-diketo-1-anthryl)amino]-2-keto-ethyl]thio]propionic acid methyl ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)CCSCC(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H17NO5S/c1-26-17(23)9-10-27-11-16(22)21-15-8-4-7-14-18(15)20(25)13-6-3-2-5-12(13)19(14)24/h2-8H,9-11H2,1H3,(H,21,22)